N-[4-[(2-oxidanylidene-5-phenyl-1,4-benzodiazepin-3-yl)methyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-[4-[(2-oxidanylidene-5-phenyl-1,4-benzodiazepin-3-yl)methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[4-[(2-oxo-5-phenyl-1,4-benzodiazepin-3-yl)methyl]thiazol-2-yl]acetamide CAS Name: N-[4-[(2-oxo-5-phenyl-1,4-benzodiazepin-3-yl)methyl]-2-thiazolyl]acetamide IUPAC Name: N-[4-[(2-oxo-5-phenyl-1,4-benzodiazepin-3-yl)methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-[4-[(2-keto-5-phenyl-1,4-benzodiazepin-3-yl)methyl]thiazol-2-yl]acetamide Formula: C21H16N4O2S MolecularWeight: 388.44234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)CC2=NC(=C3C=CC=CC3=NC2=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=NC(=CS1)CC2=NC(=C3C=CC=CC3=NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O2S/c1-13(26)22-21-23-15(12-28-21)11-18-20(27)25-17-10-6-5-9-16(17)19(24-18)14-7-3-2-4-8-14/h2-10,12H,11H2,1H3,(H,22,23,26)